9-chloranyl-5-(4-hexoxyphenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine

Systemtic Name: 9-chloranyl-5-(4-hexoxyphenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Openeye Name: 9-chloro-5-(4-hexoxyphenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine CAS Name: 9-chloro-5-(4-hexoxyphenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine IUPAC Name: 9-chloro-5-(4-hexoxyphenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Traditional Name: 9-chloro-5-(4-hexoxyphenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Formula: C28H29ClN2O2 MolecularWeight: 460.99506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=CC=C4)C5=C(O2)C=CC(=C5)Cl

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=CC=C4)C5=C(O2)C=CC(=C5)Cl

InChI

InChI=1S/C28H29ClN2O2/c1-2-3-4-8-17-32-23-14-11-21(12-15-23)28-31-26(24-18-22(29)13-16-27(24)33-28)19-25(30-31)20-9-6-5-7-10-20/h5-7,9-16,18,26,28H,2-4,8,17,19H2,1H3